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MCULE-5502584068
Compound
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- InChIKey:
- SMILES:
- InChI:
- Formula:
| Amount | Price
 Optimized compound price excluding delivery costs. Please note that automatic quote generation will optimize the total price based on your preferences.
|
Guaranteed purity (%) | Delivery time
Estimated door-to-door delivery time for EU and US customers. It will be refined and optimized during quote generation after the shipping country is specified.
|
|
|---|---|---|---|---|
| 1 mg | 74 USD | 95 | 20 working days | Get Quote |
| 5 mg | 74 USD | 95 | 20 working days | Get Quote |
| 10 mg | 74 USD | 95 | 20 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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| Name | File |
|---|---|
| SDF | MCULE-5502584068.sdf |
| SMILES | MCULE-5502584068.smiles |
| Standard InChI | MCULE-5502584068.inchi |
| InChIKey | MCULE-5502584068.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867628196 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875792050 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869366649 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-606901781 | AmBeed | In stock | N/A | As is | in stock |
| P-596965959 | Angene | Building Blocks in stock | 95 | As is | 54.3 g |
| P-889469061 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-590635123 | BLD pharm | In-stock building blocks | 95 | As is | 350 mg |
| P-871221188 | BOC Sciences | All products | N/A | As is | by resynthesis (? - ? days) |
| P-871217790 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-861385535 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-502581306 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-504613171 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
| P-596562882 | Key Organics | Building Blocks | 97 | As is | 100 mg |
| P-854692439 | MedChemExpress | Natural Products In stock | 95 | As is | in stock |
| P-500408380 | Pi Chemicals | Virtual Compounds | 95 | As is | by synthesis |
| P-888655671 | TargetMol | Screening Compounds | 95 | As is | by synthesis |
| P-869160362 | TargetMol | Screening Compounds - stock amount | 95 | As is | in stock |
| P-886958469 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 195.215 |
| logP | 1.1673 |
| H-bond acceptors | 4 |
| H-bond donors | 3 |
| Rotatable bonds | 4 |
| PSA | 69.56 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 52.8767 |
| Atoms | 27 |
| Rings | 1 |
| Heavy atoms | 14 |
| Hydrogen atoms | 13 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
